6-chloro-7-methoxy-3-propan-2-yl-1H-quinolin-2-one;5-chloro-4-methyl-2-propan-2-ylpyridine;6-chloro-3-propan-2-yl-1H-quinolin-2-one;1,2-dichloro-4-propan-2-ylbenzene;4,5-dichloro-2-propan-2-ylpyridine;1,4-di(propan-2-yl)benzene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)pyrazine;3,6-di(propan-2-yl)pyridazine;bis(2,5-di(propan-2-yl)pyridine);2,5-di(propan-2-yl)pyrimidine;1,3-di(propan-2-yl)-1,2,4-triazole;1,4-di(propan-2-yl)triazole

C140H203Cl7N20O3 — CID 161389292

IUPAC6-chloro-7-methoxy-3-propan-2-yl-1H-quinolin-2-one;5-chloro-4-methyl-2-propan-2-ylpyridine;6-chloro-3-propan-2-yl-1H-quinolin-2-one;1,2-dichloro-4-propan-2-ylbenzene;4,5-dichloro-2-propan-2-ylpyridine;1,4-di(propan-2-yl)benzene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)pyrazine;3,6-di(propan-2-yl)pyridazine;bis(2,5-di(propan-2-yl)pyridine);2,5-di(propan-2-yl)pyrimidine;1,3-di(propan-2-yl)-1,2,4-triazole;1,4-di(propan-2-yl)triazole
SMILESCC(C)c1cc(Cl)c(Cl)cn1.CC(C)c1cc2cc(Cl)ccc2[nH]c1=O.CC(C)c1ccc(C(C)C)cc1.CC(C)c1ccc(C(C)C)nc1.CC(C)c1ccc(C(C)C)nc1.CC(C)c1ccc(C(C)C)nn1.CC(C)c1ccc(Cl)c(Cl)c1.CC(C)c1cn(C(C)C)cn1.CC(C)c1cn(C(C)C)nn1.CC(C)c1cnc(C(C)C)cn1.CC(C)c1cnc(C(C)C)nc1.CC(C)c1ncn(C(C)C)n1.COc1cc2[nH]c(=O)c(C(C)C)cc2cc1Cl.Cc1cc(C(C)C)ncc1Cl
InChIInChI=1S/C13H14ClNO2.C12H12ClNO.C12H18.2C11H17N.3C10H16N2.C9H10Cl2.C9H12ClN.C9H16N2.C8H9Cl2N.2C8H15N3/c1-7(2)9-4-8-5-10(14)12(17-3)6-11(8)15-13(9)16;1-7(2)10-6-8-5-9(13)3-4-11(8)14-12(10)15;1-9(2)11-5-7-12(8-6-11)10(3)4;2*1-8(2)10-5-6-11(9(3)4)12-7-10;1-7(2)9-5-12-10(6-11-9)8(3)4;1-7(2)9-5-11-10(8(3)4)12-6-9;1-7(2)9-5-6-10(8(3)4)12-11-9;1-6(2)7-3-4-8(10)9(11)5-7;1-6(2)9-4-7(3)8(10)5-11-9;1-7(2)9-5-11(6-10-9)8(3)4;1-5(2)8-3-6(9)7(10)4-11-8;1-6(2)8-9-5-11(10-8)7(3)4;1-6(2)8-5-11(7(3)4)10-9-8/h4-7H,1-3H3,(H,15,16);3-7H,1-2H3,(H,14,15);5-10H,1-4H3;2*5-9H,1-4H3;3*5-8H,1-4H3;3-6H,1-2H3;4-6H,1-3H3;5-8H,1-4H3;3-5H,1-2H3;2*5-7H,1-4H3
InChIKeyVSTPQITTWMBFLH-UHFFFAOYSA-N
MW2462.47 g/mol
LogP42.73
Rot. Bonds24

About 6-chloro-7-methoxy-3-propan-2-yl-1H-quinolin-2-one;5-chloro-4-methyl-2-propan-2-ylpyridine;6-chloro-3-propan-2-yl-1H-quinolin-2-one;1,2-dichloro-4-propan-2-ylbenzene;4,5-dichloro-2-propan-2-ylpyridine;1,4-di(propan-2-yl)benzene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)pyrazine;3,6-di(propan-2-yl)pyridazine;bis(2,5-di(propan-2-yl)pyridine);2,5-di(propan-2-yl)pyrimidine;1,3-di(propan-2-yl)-1,2,4-triazole;1,4-di(propan-2-yl)triazole

6-chloro-7-methoxy-3-propan-2-yl-1H-quinolin-2-one;5-chloro-4-methyl-2-propan-2-ylpyridine;6-chloro-3-propan-2-yl-1H-quinolin-2-one;1,2-dichloro-4-propan-2-ylbenzene;4,5-dichloro-2-propan-2-ylpyridine;1,4-di(propan-2-yl)benzene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)pyrazine;3,6-di(propan-2-yl)pyridazine;bis(2,5-di(propan-2-yl)pyridine);2,5-di(propan-2-yl)pyrimidine;1,3-di(propan-2-yl)-1,2,4-triazole;1,4-di(propan-2-yl)triazole (PubChem CID 161389292) has the molecular formula C140H203Cl7N20O3 and a molecular weight of 2462.47 g/mol. Its IUPAC name is 6-chloro-7-methoxy-3-propan-2-yl-1H-quinolin-2-one;5-chloro-4-methyl-2-propan-2-ylpyridine;6-chloro-3-propan-2-yl-1H-quinolin-2-one;1,2-dichloro-4-propan-2-ylbenzene;4,5-dichloro-2-propan-2-ylpyridine;1,4-di(propan-2-yl)benzene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)pyrazine;3,6-di(propan-2-yl)pyridazine;bis(2,5-di(propan-2-yl)pyridine);2,5-di(propan-2-yl)pyrimidine;1,3-di(propan-2-yl)-1,2,4-triazole;1,4-di(propan-2-yl)triazole.

Molecular Properties

Compound Name6-chloro-7-methoxy-3-propan-2-yl-1H-quinolin-2-one;5-chloro-4-methyl-2-propan-2-ylpyridine;6-chloro-3-propan-2-yl-1H-quinolin-2-one;1,2-dichloro-4-propan-2-ylbenzene;4,5-dichloro-2-propan-2-ylpyridine;1,4-di(propan-2-yl)benzene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)pyrazine;3,6-di(propan-2-yl)pyridazine;bis(2,5-di(propan-2-yl)pyridine);2,5-di(propan-2-yl)pyrimidine;1,3-di(propan-2-yl)-1,2,4-triazole;1,4-di(propan-2-yl)triazole
PubChem CID161389292
Molecular FormulaC140H203Cl7N20O3
Molecular Weight2462.47 g/mol
Exact Mass2457.42
IUPAC Name6-chloro-7-methoxy-3-propan-2-yl-1H-quinolin-2-one;5-chloro-4-methyl-2-propan-2-ylpyridine;6-chloro-3-propan-2-yl-1H-quinolin-2-one;1,2-dichloro-4-propan-2-ylbenzene;4,5-dichloro-2-propan-2-ylpyridine;1,4-di(propan-2-yl)benzene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)pyrazine;3,6-di(propan-2-yl)pyridazine;bis(2,5-di(propan-2-yl)pyridine);2,5-di(propan-2-yl)pyrimidine;1,3-di(propan-2-yl)-1,2,4-triazole;1,4-di(propan-2-yl)triazole
SMILESCC(C)c1cc(Cl)c(Cl)cn1.CC(C)c1cc2cc(Cl)ccc2[nH]c1=O.CC(C)c1ccc(C(C)C)cc1.CC(C)c1ccc(C(C)C)nc1.CC(C)c1ccc(C(C)C)nc1.CC(C)c1ccc(C(C)C)nn1.CC(C)c1ccc(Cl)c(Cl)c1.CC(C)c1cn(C(C)C)cn1.CC(C)c1cn(C(C)C)nn1.CC(C)c1cnc(C(C)C)cn1.CC(C)c1cnc(C(C)C)nc1.CC(C)c1ncn(C(C)C)n1.COc1cc2[nH]c(=O)c(C(C)C)cc2cc1Cl.Cc1cc(C(C)C)ncc1Cl
InChIInChI=1S/C13H14ClNO2.C12H12ClNO.C12H18.2C11H17N.3C10H16N2.C9H10Cl2.C9H12ClN.C9H16N2.C8H9Cl2N.2C8H15N3/c1-7(2)9-4-8-5-10(14)12(17-3)6-11(8)15-13(9)16;1-7(2)10-6-8-5-9(13)3-4-11(8)14-12(10)15;1-9(2)11-5-7-12(8-6-11)10(3)4;2*1-8(2)10-5-6-11(9(3)4)12-7-10;1-7(2)9-5-12-10(6-11-9)8(3)4;1-7(2)9-5-11-10(8(3)4)12-6-9;1-7(2)9-5-6-10(8(3)4)12-11-9;1-6(2)7-3-4-8(10)9(11)5-7;1-6(2)9-4-7(3)8(10)5-11-9;1-7(2)9-5-11(6-10-9)8(3)4;1-5(2)8-3-6(9)7(10)4-11-8;1-6(2)8-9-5-11(10-8)7(3)4;1-6(2)8-5-11(7(3)4)10-9-8/h4-7H,1-3H3,(H,15,16);3-7H,1-2H3,(H,14,15);5-10H,1-4H3;2*5-9H,1-4H3;3*5-8H,1-4H3;3-6H,1-2H3;4-6H,1-3H3;5-8H,1-4H3;3-5H,1-2H3;2*5-7H,1-4H3
InChIKeyVSTPQITTWMBFLH-UHFFFAOYSA-N
XLogP42.73
TPSA283.09 Ų
H-Bond Donors2
H-Bond Acceptors21
Rotatable Bonds24
Heavy Atoms170
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002462.47
LogP ≤ 542.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1021

Analyze 6-chloro-7-methoxy-3-propan-2-yl-1H-quinolin-2-one;5-chloro-4-methyl-2-propan-2-ylpyridine;6-chloro-3-propan-2-yl-1H-quinolin-2-one;1,2-dichloro-4-propan-2-ylbenzene;4,5-dichloro-2-propan-2-ylpyridine;1,4-di(propan-2-yl)benzene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)pyrazine;3,6-di(propan-2-yl)pyridazine;bis(2,5-di(propan-2-yl)pyridine);2,5-di(propan-2-yl)pyrimidine;1,3-di(propan-2-yl)-1,2,4-triazole;1,4-di(propan-2-yl)triazole with MolForge

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Launch Full Analysis

Related Compounds

6-chloro-7-methoxy-3-propan-2-yl-1,2-dihydroquinoline;6-chloro-7-methoxy-3-propan-2-ylquinoline;6-chloro-7-methoxy-3-propan-2-yl-1H-quinolin-2-one;5-chloro-4-methyl-2-propan-2-ylpyridine;6-chloro-3-propan-2-yl-1H-quinolin-2-one;4,5-dichloro-2-propan-2-ylpyridine;1-(4-fluoro-3-methylphenyl)-4-propan-2-ylimidazole;2-(4-fluoro-3-methylphenyl)-5-propan-2-ylpyrazine;3-(4-fluoro-3-methylphenyl)-6-propan-2-ylpyridazine;1-(4-fluoro-3-methylphenyl)-3-propan-2-yl-1,2,4-triazole;5-phenoxy-2-propan-2-ylpyridine;4-propan-2-yl-1-[4-(trifluoromethyl)phenyl]triazole
CID 161559894
3-chloro-2-methoxy-6-propan-2-ylnaphthalene;6-chloro-7-methoxy-3-propan-2-ylquinoline;6-chloro-7-methoxy-3-propan-2-yl-1H-quinolin-2-one;5-chloro-4-methyl-2-propan-2-ylpyridine;6-chloro-3-propan-2-yl-1H-quinolin-2-one;1,2-dichloro-4-propan-2-ylbenzene;4,5-dichloro-2-propan-2-ylpyridine;1,4-di(propan-2-yl)benzene;2,5-di(propan-2-yl)cyclohexa-2,4-dien-1-one;bis(1,4-di(propan-2-yl)imidazole);2,6-di(propan-2-yl)naphthalene;2,5-di(propan-2-yl)pyrazine;3,6-di(propan-2-yl)pyridazine;bis(2,5-di(propan-2-yl)pyridine);3,6-di(propan-2-yl)-1H-pyridin-2-one;2,5-di(propan-2-yl)pyrimidine;1,3-di(propan-2-yl)-1,2,4-triazole;1,4-di(propan-2-yl)triazole
CID 160718630

Frequently Asked Questions

What is the IUPAC name of 6-chloro-7-methoxy-3-propan-2-yl-1H-quinolin-2-one;5-chloro-4-methyl-2-propan-2-ylpyridine;6-chloro-3-propan-2-yl-1H-quinolin-2-one;1,2-dichloro-4-propan-2-ylbenzene;4,5-dichloro-2-propan-2-ylpyridine;1,4-di(propan-2-yl)benzene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)pyrazine;3,6-di(propan-2-yl)pyridazine;bis(2,5-di(propan-2-yl)pyridine);2,5-di(propan-2-yl)pyrimidine;1,3-di(propan-2-yl)-1,2,4-triazole;1,4-di(propan-2-yl)triazole?
The IUPAC name of 6-chloro-7-methoxy-3-propan-2-yl-1H-quinolin-2-one;5-chloro-4-methyl-2-propan-2-ylpyridine;6-chloro-3-propan-2-yl-1H-quinolin-2-one;1,2-dichloro-4-propan-2-ylbenzene;4,5-dichloro-2-propan-2-ylpyridine;1,4-di(propan-2-yl)benzene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)pyrazine;3,6-di(propan-2-yl)pyridazine;bis(2,5-di(propan-2-yl)pyridine);2,5-di(propan-2-yl)pyrimidine;1,3-di(propan-2-yl)-1,2,4-triazole;1,4-di(propan-2-yl)triazole (CID 161389292) is 6-chloro-7-methoxy-3-propan-2-yl-1H-quinolin-2-one;5-chloro-4-methyl-2-propan-2-ylpyridine;6-chloro-3-propan-2-yl-1H-quinolin-2-one;1,2-dichloro-4-propan-2-ylbenzene;4,5-dichloro-2-propan-2-ylpyridine;1,4-di(propan-2-yl)benzene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)pyrazine;3,6-di(propan-2-yl)pyridazine;bis(2,5-di(propan-2-yl)pyridine);2,5-di(propan-2-yl)pyrimidine;1,3-di(propan-2-yl)-1,2,4-triazole;1,4-di(propan-2-yl)triazole.
What is the SMILES notation for 6-chloro-7-methoxy-3-propan-2-yl-1H-quinolin-2-one;5-chloro-4-methyl-2-propan-2-ylpyridine;6-chloro-3-propan-2-yl-1H-quinolin-2-one;1,2-dichloro-4-propan-2-ylbenzene;4,5-dichloro-2-propan-2-ylpyridine;1,4-di(propan-2-yl)benzene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)pyrazine;3,6-di(propan-2-yl)pyridazine;bis(2,5-di(propan-2-yl)pyridine);2,5-di(propan-2-yl)pyrimidine;1,3-di(propan-2-yl)-1,2,4-triazole;1,4-di(propan-2-yl)triazole?
The canonical SMILES for 6-chloro-7-methoxy-3-propan-2-yl-1H-quinolin-2-one;5-chloro-4-methyl-2-propan-2-ylpyridine;6-chloro-3-propan-2-yl-1H-quinolin-2-one;1,2-dichloro-4-propan-2-ylbenzene;4,5-dichloro-2-propan-2-ylpyridine;1,4-di(propan-2-yl)benzene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)pyrazine;3,6-di(propan-2-yl)pyridazine;bis(2,5-di(propan-2-yl)pyridine);2,5-di(propan-2-yl)pyrimidine;1,3-di(propan-2-yl)-1,2,4-triazole;1,4-di(propan-2-yl)triazole is CC(C)c1cc(Cl)c(Cl)cn1.CC(C)c1cc2cc(Cl)ccc2[nH]c1=O.CC(C)c1ccc(C(C)C)cc1.CC(C)c1ccc(C(C)C)nc1.CC(C)c1ccc(C(C)C)nc1.CC(C)c1ccc(C(C)C)nn1.CC(C)c1ccc(Cl)c(Cl)c1.CC(C)c1cn(C(C)C)cn1.CC(C)c1cn(C(C)C)nn1.CC(C)c1cnc(C(C)C)cn1.CC(C)c1cnc(C(C)C)nc1.CC(C)c1ncn(C(C)C)n1.COc1cc2[nH]c(=O)c(C(C)C)cc2cc1Cl.Cc1cc(C(C)C)ncc1Cl.
What is the InChIKey of 6-chloro-7-methoxy-3-propan-2-yl-1H-quinolin-2-one;5-chloro-4-methyl-2-propan-2-ylpyridine;6-chloro-3-propan-2-yl-1H-quinolin-2-one;1,2-dichloro-4-propan-2-ylbenzene;4,5-dichloro-2-propan-2-ylpyridine;1,4-di(propan-2-yl)benzene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)pyrazine;3,6-di(propan-2-yl)pyridazine;bis(2,5-di(propan-2-yl)pyridine);2,5-di(propan-2-yl)pyrimidine;1,3-di(propan-2-yl)-1,2,4-triazole;1,4-di(propan-2-yl)triazole?
The InChIKey is VSTPQITTWMBFLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14ClNO2.C12H12ClNO.C12H18.2C11H17N.3C10H16N2.C9H10Cl2.C9H12ClN.C9H16N2.C8H9Cl2N.2C8H15N3/c1-7(2)9-4-8-5-10(14)12(17-3)6-11(8)15-13(9)16;1-7(2)10-6-8-5-9(13)3-4-11(8)14-12(10)15;1-9(2)11-5-7-12(8-6-11)10(3)4;2*1-8(2)10-5-6-11(9(3)4)12-7-10;1-7(2)9-5-12-10(6-11-9)8(3)4;1-7(2)9-5-11-10(8(3)4)12-6-9;1-7(2)9-5-6-10(8(3)4)12-11-9;1-6(2)7-3-4-8(10)9(11)5-7;1-6(2)9-4-7(3)8(10)5-11-9;1-7(2)9-5-11(6-10-9)8(3)4;1-5(2)8-3-6(9)7(10)4-11-8;1-6(2)8-9-5-11(10-8)7(3)4;1-6(2)8-5-11(7(3)4)10-9-8/h4-7H,1-3H3,(H,15,16);3-7H,1-2H3,(H,14,15);5-10H,1-4H3;2*5-9H,1-4H3;3*5-8H,1-4H3;3-6H,1-2H3;4-6H,1-3H3;5-8H,1-4H3;3-5H,1-2H3;2*5-7H,1-4H3.
What are the key properties of 6-chloro-7-methoxy-3-propan-2-yl-1H-quinolin-2-one;5-chloro-4-methyl-2-propan-2-ylpyridine;6-chloro-3-propan-2-yl-1H-quinolin-2-one;1,2-dichloro-4-propan-2-ylbenzene;4,5-dichloro-2-propan-2-ylpyridine;1,4-di(propan-2-yl)benzene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)pyrazine;3,6-di(propan-2-yl)pyridazine;bis(2,5-di(propan-2-yl)pyridine);2,5-di(propan-2-yl)pyrimidine;1,3-di(propan-2-yl)-1,2,4-triazole;1,4-di(propan-2-yl)triazole?
6-chloro-7-methoxy-3-propan-2-yl-1H-quinolin-2-one;5-chloro-4-methyl-2-propan-2-ylpyridine;6-chloro-3-propan-2-yl-1H-quinolin-2-one;1,2-dichloro-4-propan-2-ylbenzene;4,5-dichloro-2-propan-2-ylpyridine;1,4-di(propan-2-yl)benzene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)pyrazine;3,6-di(propan-2-yl)pyridazine;bis(2,5-di(propan-2-yl)pyridine);2,5-di(propan-2-yl)pyrimidine;1,3-di(propan-2-yl)-1,2,4-triazole;1,4-di(propan-2-yl)triazole has a molecular weight of 2462.47 g/mol, XLogP of 42.73, 24 rotatable bonds, 2 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-7-methoxy-3-propan-2-yl-1H-quinolin-2-one;5-chloro-4-methyl-2-propan-2-ylpyridine;6-chloro-3-propan-2-yl-1H-quinolin-2-one;1,2-dichloro-4-propan-2-ylbenzene;4,5-dichloro-2-propan-2-ylpyridine;1,4-di(propan-2-yl)benzene;1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)pyrazine;3,6-di(propan-2-yl)pyridazine;bis(2,5-di(propan-2-yl)pyridine);2,5-di(propan-2-yl)pyrimidine;1,3-di(propan-2-yl)-1,2,4-triazole;1,4-di(propan-2-yl)triazole is sourced from PubChem (CID 161389292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).